Geometry & MOs

Info

ID:	251065
PubChem CID:	103101231
Reduced:	OF3N4C11H15 (1)
Stoich.:	AB3C4D11E15 (1)
Weight, g/mol:	225.12774
ΔH_f, kcal/mol:	-174.26
Dipole, Da:	4.0
IP(EA), eV:	-9.52(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(aminomethyl)-N-ethyl-3-fluoroanilino]acetamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C1=C(C=CC(=N1)C(F)(F)F)CN

DOS

IR

Vibrations